7-[2,5-bis(oxidanylidene)piperazin-1-yl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[2,5-bis(oxidanylidene)piperazin-1-yl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(2,5-dioxopiperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(2,5-dioxo-1-piperazinyl)-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(2,5-dioxopiperazin-1-yl)-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(2,5-diketopiperazino)-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C16H14FN3O5 MolecularWeight: 347.297863

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC(=O)NCC3=O)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC(=O)NCC3=O)F)C(=O)O

InChI

InChI=1S/C16H14FN3O5/c1-2-19-6-9(16(24)25)15(23)8-3-10(17)12(4-11(8)19)20-7-13(21)18-5-14(20)22/h3-4,6H,2,5,7H2,1H3,(H,18,21)(H,24,25)